COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.500  -2.640  -0.349  1.00  0.00           C  
HETATM    2  N   UNL     1      -3.874   5.650   0.351  1.00  0.00           N  
HETATM    3  C   UNL     1      -4.156   4.415   0.854  1.00  0.00           C  
HETATM    4  N   UNL     1      -5.365   4.206   1.468  1.00  0.00           N  
HETATM    5  N   UNL     1      -3.303   3.419   0.769  1.00  0.00           N  
HETATM    6  C   UNL     1      -2.112   3.576   0.179  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.764   4.821  -0.358  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.691   5.885  -0.259  1.00  0.00           C  
HETATM    9  O   UNL     1      -2.429   6.986  -0.713  1.00  0.00           O  
HETATM   10  N   UNL     1      -0.521   4.698  -0.886  1.00  0.00           N  
HETATM   11  C   UNL     1      -0.097   3.481  -0.709  1.00  0.00           C  
HETATM   12  N   UNL     1      -1.046   2.750  -0.055  1.00  0.00           N  
HETATM   13  P   UNL     1       4.313  -1.058  -0.418  1.00  0.00           P  
HETATM   14  P   UNL     1       6.987  -0.164   0.496  1.00  0.00           P  
HETATM   15  C   UNL     1      -3.343  -3.570   0.421  1.00  0.00           C  
HETATM   16  O   UNL     1      -2.562  -2.626  -1.562  1.00  0.00           O  
HETATM   17  O   UNL     1       4.509  -0.417  -1.738  1.00  0.00           O  
HETATM   18  C   UNL     1      -0.944   1.340   0.326  1.00  0.00           C  
HETATM   19  O   UNL     1       7.835  -1.532   0.455  1.00  0.00           O  
HETATM   20  C   UNL     1      -4.303  -4.360  -0.232  1.00  0.00           C  
HETATM   21  N   UNL     1      -4.462  -4.269  -1.608  1.00  0.00           N  
HETATM   22  O   UNL     1      -3.000   0.294  -0.512  1.00  0.00           O  
HETATM   23  O   UNL     1       4.464  -2.654  -0.568  1.00  0.00           O  
HETATM   24  C   UNL     1      -1.598   0.434  -0.748  1.00  0.00           C  
HETATM   25  O   UNL     1       7.230   0.605  -0.745  1.00  0.00           O  
HETATM   26  C   UNL     1      -5.092  -5.234   0.506  1.00  0.00           C  
HETATM   27  O   UNL     1      -1.664  -1.800   0.293  1.00  0.00           O  
HETATM   28  O   UNL     1       5.419  -0.509   0.615  1.00  0.00           O  
HETATM   29  C   UNL     1      -0.863  -0.911  -0.530  1.00  0.00           C  
HETATM   30  O   UNL     1       7.442   0.712   1.768  1.00  0.00           O  
HETATM   31  C   UNL     1      -4.931  -5.323   1.873  1.00  0.00           C  
HETATM   32  O   UNL     1       0.436   0.914   0.332  1.00  0.00           O  
HETATM   33  C   UNL     1       0.433  -0.518   0.205  1.00  0.00           C  
HETATM   34  C   UNL     1      -3.986  -4.544   2.522  1.00  0.00           C  
HETATM   35  O   UNL     1       2.842  -0.708   0.134  1.00  0.00           O  
HETATM   36  C   UNL     1       1.649  -0.971  -0.607  1.00  0.00           C  
HETATM   37  C   UNL     1      -3.190  -3.676   1.807  1.00  0.00           C  
HETATM   38  C   UNL     1      -5.544  -5.001  -2.271  1.00  0.00           C  
HETATM   39  H   UNL     1      -4.527   6.363   0.427  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.005   4.932   1.539  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.580   3.333   1.831  1.00  0.00           H  
HETATM   42  H   UNL     1       0.863   3.105  -1.032  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.403   1.173   1.301  1.00  0.00           H  
HETATM   44  H   UNL     1       7.724  -2.087   1.239  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.856  -3.721  -2.131  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.490   1.126  -0.548  1.00  0.00           H  
HETATM   47  H   UNL     1       4.347  -3.139   0.260  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.411   0.822  -1.750  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.831  -5.844   0.009  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.635  -1.381  -1.486  1.00  0.00           H  
HETATM   51  H   UNL     1       8.378   0.956   1.762  1.00  0.00           H  
HETATM   52  H   UNL     1      -5.547  -6.004   2.442  1.00  0.00           H  
HETATM   53  H   UNL     1       0.453  -0.978   1.193  1.00  0.00           H  
HETATM   54  H   UNL     1      -3.869  -4.621   3.592  1.00  0.00           H  
HETATM   55  H   UNL     1       1.574  -2.040  -0.808  1.00  0.00           H  
HETATM   56  H   UNL     1       1.679  -0.425  -1.550  1.00  0.00           H  
HETATM   57  H   UNL     1      -2.452  -3.075   2.317  1.00  0.00           H  
HETATM   58  H   UNL     1      -5.424  -6.069  -2.089  1.00  0.00           H  
HETATM   59  H   UNL     1      -6.503  -4.670  -1.872  1.00  0.00           H  
HETATM   60  H   UNL     1      -5.510  -4.808  -3.343  1.00  0.00           H  
CONECT    1   15   16   16   27                                       
CONECT    2    3    8   39                                            
CONECT    3    2    4    5    5                                       
CONECT    4    3   40   41                                            
CONECT    5    3    3    6                                            
CONECT    6    5    7    7   12                                       
CONECT    7    6    6    8   10                                       
CONECT    8    2    7    9    9                                       
CONECT    9    8    8                                                 
CONECT   10    7   11   11                                            
CONECT   11   10   10   12   42                                       
CONECT   12    6   11   18                                            
CONECT   13   17   17   23   28                                       
CONECT   13   35                                                      
CONECT   14   19   25   25   28                                       
CONECT   14   30                                                      
CONECT   15    1   20   20   37                                       
CONECT   16    1    1                                                 
CONECT   17   13   13                                                 
CONECT   18   12   24   32   43                                       
CONECT   19   14   44                                                 
CONECT   20   15   15   21   26                                       
CONECT   21   20   38   45                                            
CONECT   22   24   46                                                 
CONECT   23   13   47                                                 
CONECT   24   18   22   29   48                                       
CONECT   25   14   14                                                 
CONECT   26   20   31   31   49                                       
CONECT   27    1   29                                                 
CONECT   28   13   14                                                 
CONECT   29   24   27   33   50                                       
CONECT   30   14   51                                                 
CONECT   31   26   26   34   52                                       
CONECT   32   18   33                                                 
CONECT   33   29   32   36   53                                       
CONECT   34   31   37   37   54                                       
CONECT   35   13   36                                                 
CONECT   36   33   35   55   56                                       
CONECT   37   15   34   34   57                                       
CONECT   38   21   58   59   60                                       
CONECT   39    2                                                      
CONECT   40    4                                                      
CONECT   41    4                                                      
CONECT   42   11                                                      
CONECT   43   18                                                      
CONECT   44   19                                                      
CONECT   45   21                                                      
CONECT   46   22                                                      
CONECT   47   23                                                      
CONECT   48   24                                                      
CONECT   49   26                                                      
CONECT   50   29                                                      
CONECT   51   30                                                      
CONECT   52   31                                                      
CONECT   53   33                                                      
CONECT   54   34                                                      
CONECT   55   36                                                      
CONECT   56   36                                                      
CONECT   57   37                                                      
CONECT   58   38                                                      
CONECT   59   38                                                      
CONECT   60   38                                                      
MASTER        0    0    0    0    0    0    0    0   60    0   60    0
END
